SCHEMBL11047604

SCHEMBL11047604

Cc1cccc(C)c1-n1cnc(CO)c1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR1 Q9BXC0 3/20 0.45
ALDH1A1 P00352 7/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KDM4E B2RXH2 1/20 0.34
HSD17B10 Q99714 3/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
HPGD P15428 1/20 0.34
HIF1A Q16665 1/20 0.34
HTR1A P08908 1/20 0.33
ADRA1D P25100 1/20 0.33
ADRA1A P35348 1/20 0.33
ADRA1B P35368 1/20 0.33
ATP4A P20648 1/20 0.32
ATP4B P51164 1/20 0.32
FGFR1 P11362 1/20 0.31
SRC P12931 1/20 0.31
NOTUM Q6P988 3/20 0.31
TSHR P16473 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11050864 0.82 HCAR1 (0.46) HCAR1ALDH1A1KDM4EHSD17B10CYP1A2
SCHEMBL11051880 0.81 ALDH1A1 (0.47) HCAR1ALDH1A1KDM4EHSD17B10CYP1A2
SCHEMBL11101297 0.77 FGFR1 (0.47) ALDH1A1L3MBTL1HSD17B10CYP1A2CYP2D6
SCHEMBL21621663 0.74 ALDH1A1 (0.41) HCAR1ALDH1A1L3MBTL1KDM4EHSD17B10
SCHEMBL2234758 0.74 HCAR1 (0.36) HCAR1ALDH1A1L3MBTL1NOTUMMAPT
SCHEMBL10515640 0.73 HCAR1 (0.45) HCAR1ALDH1A1HSD17B10CYP1A2CYP2D6
SCHEMBL16935829 0.71 HCAR1 (0.44) HCAR1ALDH1A1L3MBTL1KDM4EHSD17B10
SCHEMBL23458074 0.70 CCR1 (0.34) ALDH1A1KDM4EHTR1ANOTUMMAPT
SCHEMBL29051025 0.70 PI4KA (0.42) HCAR1ALDH1A1KDM4EHSD17B10CYP1A2
SCHEMBL23458100 0.70 ALDH1A1 (0.43) ALDH1A1L3MBTL1KDM4EHSD17B10CYP1A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0024829-B1 4-BENZYL- AND 4-BENZOYLIMIDAZOLE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME Farmos-Yhtyma Oy (FI) 1984-04-25 EP claimed
US-4443466-A DIURETICS, SEDATIVES, ANALGESICS Farmos-Yhtyma OY (Farmos Group Ltd.) (FI) 1984-04-17 US claimed
EP-0024829-A1 4-Benzyl- and 4-benzoylimidazole derivatives, processes for their preparation and pharmaceutical compositions comprising the same Farmos-Yhtyma Oy (FI) 1981-03-11 EP claimed
EP-0024829-B1 4-BENZYL- AND 4-BENZOYLIMIDAZOLE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME Farmos-Yhtyma Oy (FI) 1984-04-25 EP disclosed
US-4443466-A DIURETICS, SEDATIVES, ANALGESICS Farmos-Yhtyma OY (Farmos Group Ltd.) (FI) 1984-04-17 US disclosed